• Formula : Ag3P
  • Space Group : Pm-3n (223)
    Centrosymmetric : True
    Dimensionality : 3D
  • Structure parameters
    a = 6.0
    b = 6.0
    c = 6.0
    α = 90.0
    β = 90.0
    γ = 90.0
  • Number of atoms per primitive cell = 8
    Total number of electrons per primitive cell = 76
  • Band gap = 0.0 eV
    Direct Gap = 0.001 eV
    Metallicity = 0.278
    Topological Z2 indices ν = (0;000)
  • cif file - scf.in - scf.out - bands.in - bands.out
  • Reference:

    Crystal structure of silver phosphate and silver arsenate (Ag3 X O4) _cod_database_code 1010605,
    American Journal of Science 10, 107 (1925)

Band structure with spin-orbit coupling